ChemSpider 2D Image | 4-{(1E)-1-[2-(4-Acetoxyphenyl)-3-methyl-2-oxiranyl]-1-propen-1-yl}phenyl acetate | C22H22O5

4-{(1E)-1-[2-(4-Acetoxyphenyl)-3-methyl-2-oxiranyl]-1-propen-1-yl}phenyl acetate

  • Molecular FormulaC22H22O5
  • Average mass366.407 Da
  • Monoisotopic mass366.146729 Da
  • ChemSpider ID57471399

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-{(1E)-1-[2-(4-Acetoxyphenyl)-3-methyl-2-oxiranyl]-1-propen-1-yl}phenyl acetate [ACD/IUPAC Name]
4-{(1E)-1-[2-(4-Acetoxyphenyl)-3-methyl-2-oxiranyl]-1-propen-1-yl}phenyl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-{(1E)-1-[2-(4-acétoxyphényl)-3-méthyl-2-oxiranyl]-1-propén-1-yl}phényle [French] [ACD/IUPAC Name]
Phenol, 4-[(1E)-1-[2-[4-(acetyloxy)phenyl]-3-methyloxiranyl]-1-propen-1-yl]-, acetate [ACD/Index Name]
2,3-Epoxy-3,4-bis(4'-acetoxyphenyl)-4-hexene

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 504.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 219.8±30.2 °C
Index of Refraction: 1.571
Molar Refractivity: 101.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.57
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 488.40
ACD/KOC (pH 5.5): 2925.68
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 488.40
ACD/KOC (pH 7.4): 2925.68
Polar Surface Area: 65 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 308.5±3.0 cm3

Click to predict properties on the Chemicalize site


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